N-[(2S)-5-methylhexan-2-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-[(2S)-5-methylhexan-2-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-[(1S)-1,4-dimethylpentyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-[(2S)-5-methylhexan-2-yl]-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-[(2S)-5-methylhexan-2-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-[(1S)-1,4-dimethylpentyl]-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C20H32N2O3S MolecularWeight: 380.54468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

C[C@@H](CCC(C)C)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C20H32N2O3S/c1-16(2)6-7-17(3)21-20(23)13-10-18-8-11-19(12-9-18)26(24,25)22-14-4-5-15-22/h8-9,11-12,16-17H,4-7,10,13-15H2,1-3H3,(H,21,23)/t17-/m0/s1